2-methoxycarbonyl-5,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylic acid

Systemtic Name: 2-methoxycarbonyl-5,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylic acid Openeye Name: 2-methoxycarbonyl-5,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylic acid CAS Name: 2-methoxycarbonyl-5,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylic acid IUPAC Name: 2-methoxycarbonyl-5,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylic acid Traditional Name: 2-carbomethoxy-5,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylic acid Formula: C16H16N2O6 MolecularWeight: 332.30804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)O)C(=O)OC)C

Isomeric SMILES

CC1=C(NC(=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)O)C(=O)OC)C

InChI

InChI=1S/C16H16N2O6/c1-8-9(2)17-14(16(21)24-3)13(15(19)20)12(8)10-5-4-6-11(7-10)18(22)23/h4-7,12,17H,1-3H3,(H,19,20)